2-[5-chloranyl-2-(2-morpholin-4-ylethoxy)phenyl]-4-ethyl-1,3-thiazole-5-carboxylic acid

Systemtic Name: 2-[5-chloranyl-2-(2-morpholin-4-ylethoxy)phenyl]-4-ethyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[5-chloro-2-(2-morpholinoethoxy)phenyl]-4-ethyl-thiazole-5-carboxylic acid CAS Name: 2-[5-chloro-2-[2-(4-morpholinyl)ethoxy]phenyl]-4-ethyl-5-thiazolecarboxylic acid IUPAC Name: 2-[5-chloro-2-(2-morpholin-4-ylethoxy)phenyl]-4-ethyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[5-chloro-2-(2-morpholinoethoxy)phenyl]-4-ethyl-thiazole-5-carboxylic acid Formula: C18H21ClN2O4S MolecularWeight: 396.88834

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=N1)C2=C(C=CC(=C2)Cl)OCCN3CCOCC3)C(=O)O

Isomeric SMILES

CCC1=C(SC(=N1)C2=C(C=CC(=C2)Cl)OCCN3CCOCC3)C(=O)O

InChI

InChI=1S/C18H21ClN2O4S/c1-2-14-16(18(22)23)26-17(20-14)13-11-12(19)3-4-15(13)25-10-7-21-5-8-24-9-6-21/h3-4,11H,2,5-10H2,1H3,(H,22,23)